santalyl butyrate
butanoic acid, 5-(2,3-dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-2-pentenyl ester

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Name: [(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enyl] butanoate CAS Number: 67633-99-2 3D/inchi ECHA EINECS - REACH Pre-Reg: 266-801-4 FDA UNII: Search Nikkaji Web: J342.638F XlogP3-AA: 5.40 (est) Molecular Weight: 290.44650000 Formula: C19 H30 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavor and fragrance agents   US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information: Google Scholar: Search Google Books: Search Google Scholar: with word "volatile" Search Google Scholar: with word "flavor" Search Google Scholar: with word "odor" Search Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: colorless clear liquid (est) Assay: 80.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.96200 to 0.97000 @ 25.00 °C. Pounds per Gallon - (est).: 8.005 to 8.071 Specific Gravity: 0.96300 to 0.97100 @ 20.00 °C. Pounds per Gallon - est.: 8.022 to 8.089 Refractive Index: 1.48200 to 1.48800 @ 20.00 °C. Boiling Point: 357.00 to 358.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.000028 mmHg @ 25.00 °C. (est) Flash Point: > 212.00 °F. TCC ( > 100.00 °C. ) logP (o/w): 6.418 (est) Soluble in:   alcohol   water, 0.0162 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: woody Odor Strength:medium Substantivity:312 hour(s) at 100.00 % woody balsamic fruity rose nutty Odor Description:at 100.00 %. woody balsam fruity rose nutty Luebke, William tgsc, (1989) Odor sample from: International Flavors & Fragrances Inc. Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers:   None found   Safety Information: European information : Most important hazard(s): Xi - Irritant R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing.   Hazards identification   Classification of the substance or mixture GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) None found. GHS Label elements, including precautionary statements   Pictogram   Hazard statement(s) None found. Precautionary statement(s) None found. Oral/Parenteral Toxicity: Not determined Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavor and fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice Recommendation for santalyl butyrate usage levels up to:   10.0000 % in the fragrance concentrate.     Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):67633-99-2 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :6437243 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 [(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enyl] butanoate Chemidplus:0067633992   References:   [(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enyl] butanoate NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 67633-99-2 Pubchem (cid): 6437243 Pubchem (sid): 135064588   Other Information: (IUPAC): Atomic Weights of the Elements 2011 (pdf) Videos: The Periodic Table of Videos tgsc: Atomic Weights use for this web site (IUPAC): Periodic Table of the Elements HMDB (The Human Metabolome Database): Search Export Tariff Code: 2915.60.0000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these eremophila mitchelli wood oil australia FR (E)- sabinene hydrate FL/FR acidic acidic 2- methyl-2-pentenoic acid FL/FR alcoholic fusel oil FL/FR anisic para- anisyl phenyl acetate FL/FR aromatic damascone carboxylate FR balsamic iso amyl benzoate FL/FR amyris wood oil FL/FR amyris wood oil replacer FR balsam fir oleoresin FL/FR siam benzoin absolute FL/FR siam benzoin resin FL/FR siam benzoin resinoid FL/FR benzoin resinoid replacer FR 1- benzoyl acetone FL/FR benzyl cinnamate FL/FR laevo- bornyl acetate FL/FR brachyleana hutchinsii wood oil FR butyl benzoate FL/FR iso butyl cinnamate FL/FR callitropsis araucarioides wood oil FR (E)- cinnamyl butyrate FL/FR cinnamyl butyrate FL/FR cinnamyl formate FL/FR cistus leaf oil FR conifer acetate FR copaifera reticulata extract FL/FR croton glabellus bark extract FL/FR ethyl cinnamate FL/FR fir balsam absolute (abies balsamea) FR fir carboxylate FR fir needle oil canada FL/FR fir needle oil terpeneless canada FL/FR guaiyl butyrate FR gurjun balsam FR hemlock western oil (tsuga heterophylla) canada FR hexyl cinnamate FR juniper absolute FL/FR juniper berry absolute FL/FR juniper berry oil CO2 extract FL/FR methyl hydrogenated rosinate FR myrrh absolute FL/FR myrrh gum FL/FR myrrh resin FL/FR myrrh resinoid FR myrrh resinoid replacer FR octyl benzoate FR opoponax absolute (commiphora erythraea var. glabrescens engle) FL/FR opoponax absolute replacer FR opoponax resinoid (commiphora erythraea var. glabrescens engle) FR opoponax resinoid replacer FR peru balsam absolute FL/FR phenyl salicylate FR pine needle absolute FL/FR scotch pine wood/needles resinoid FR pistacia lentiscus gum water FR prenyl benzoate FL/FR iso propyl cinnamate FL/FR quercus robur oil FR styrax speciality FR terpinyl butyrate FL/FR tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR valeriana wallichii root oil FR chocolate cocoa pentenal FL/FR fatty hexyl pivalate FR fir needle abies amabilis oil canada FR floral alpha- amyl cinnamyl acetate FL/FR anise indene FR benzyl acetone FL/FR benzyl alcohol FL/FR benzyl isobutyrate FL/FR boronia absolute FL/FR cananga oil FL/FR cananga oil china FL/FR cassis buteneone FR citronellal diisotridecyl acetal FR citronellyl acetate FL/FR citronellyl anthranilate FL/FR citronellyl hexanoate FL/FR citronellyl propionate FL/FR (E)- citronellyl tiglate FL/FR 2-para- cresyl oxyethyl acetate FR 3- cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester FR beta- damascenone FL/FR delta- damascone FL/FR dimethyl benzyl carbinyl acetate FL/FR ethyl linalyl acetate FR ethyl ortho-anisate FL/FR eucalyptus macarthurii oil FR florida breeze fragrance FR gardenia pentyl acetate FR geraniol FL/FR geranium oil egypt fractions FR geranyl formate FL/FR geranyl isobutyrate FL/FR geranyl phenyl acetate FL/FR geranyl propionate FL/FR geranyl valerate FL/FR beta- ionol FL/FR beta- ionone FL/FR linaloe wood oil mexico FL/FR N- methyl ionone FR alpha-iso methyl ionone (90% min.) FL/FR petitgrain lemon oil FL/FR phenethyl isobutyrate FL/FR phenethyl isovalerate FL/FR phenethyl propionate FL/FR 2- phenethyl valerate FL/FR 4- phenyl-3-buten-2-ol FL/FR rhodinyl butyrate FL/FR rose absolute (rosa centifolia) morocco FL/FR rose butanoate FL/FR styralyl propionate FL/FR jasmin absolute (jasminum flexile) FR fresh 10- undecen-1-yl acetate FL/FR fruity allyl (E)-cinnamate FL/FR allyl cinnamate FL/FR allyl isononylate FR balsam specialty FR (E)- cinnamyl propionate FL/FR dihydroactinidolide FL/FR (E)- ethyl tiglate FL/FR (E,Z)-6- ethyl-5,7-dimethyl-2,5-octadien-4-one FR fruity butanate FR geranyl butyrate FL/FR green acetate FR linalool oxide acetates FL/FR octyl formate FL/FR 3- phenyl propyl isobutyrate FL/FR (E,E)- pomarose FR thesaron (Takasago) FR green holy basil leaf oil FL/FR galbanum absolute FL/FR galbanum oil FL/FR galbanum oil replacer FR galbanum oleoresin FL/FR galbanum resinoid FL/FR hexyl phenyl acetate FL/FR picea glauca leaf absolute FR pinus cembra leaf twig oil FR valerian rhizome oil CO2 extract china FL/FR herbal artemisia vestita wall. leaf oil FR calendula officinalis flower oil CO2 extract FR camphor wood oil decamphorised FR cananga fruit oil FR canarium luzonicum gum FL/FR chamomile absolute FL/FR coriander oleoresin FL/FR elemi resinoid replacer FR florida soap fragrance FR geranium cyclohexane FR geranyl octanoate FL/FR herbal undecanone FR lavender oil australia FL/FR linalyl formate FL/FR marigold pot flower oil FL/FR methyl cyclogeranate (Firmenich) FR nonisyl acetate FR ormenis multicaulis flower oil morocco FR patchouli oil terpenes FR rosemary absolute FL/FR rosemary oil FL/FR rosemary oil africa FL/FR rosemary oil morocco FL/FR rosemary oil replacer FR rosemary oil spain FL/FR rosemary oil tunisia FL/FR green tea leaf absolute FL/FR valerian rhizome oil FL/FR valerian rhizome oil china FL/FR nutty sesame absolute FL/FR sesame absolute CO2 extract FL/FR pine abies sibirica needle extract FR white pine bark oil FL/FR pine forest fragrance FR pine specialty FR rummy rum fragrance FR smoky boswellia serrata wood tar oil FR spicy cananga leaf oil FR cardamom oil replacer FR cinnamomum culilawan bark oil FR cinnamyl propionate FL/FR clove bud oil FL/FR clove bud oil replacer FR clove leaf oil FL/FR N,N- diethyl octanamide FR elettaria cardamomum seed oil FL/FR elettaria cardamomum seed oil guatemala FL/FR myristica fragrans fruit extract FL/FR myristica fragrans seed tincture FL/FR myristicin FR nutmeg absolute FL/FR (E)- propyl 2-furan acrylate FL/FR spicy acetoacetate FL/FR terpenic elemi resinoid FL/FR pine needle oil dwarf FL/FR turpentine oil FL/FR tobacco honey absolute FL/FR tonka tonka undecanone FR waxy dihydrocitronellyl acetate FL/FR ethyl nonanoate FL/FR phytyl acetate FL/FR winey butyl angelate FL/FR woody agarwood oil FR agarwood oil CO2 extract FR agarwood specialty FR mountain ash fragrance FR bulnesia sarmienti extract FR callitris columellaris wood oil australia FR callitris intratropica wood oil australia FR cedanol FR cedarwood acetate FR cedarwood oil texas fractions FR cistus twig/leaf absolute FR copaiba balsam FL/FR 2- decalinyl acetate FR eremophila mitchelli wood oil CO2 extract FR guaiacwood oil FL/FR alpha- guaiene FL/FR gurjun balsam oil FR alpha- gurjunene FR 4- hydroxybenzaldehyde FL/FR kaempferia galanga rhizome oil FL/FR patchouli absolute FR patchouli extract acetylated FR patchouli oil FL/FR sandal cyclohexanol FR (R)- sandal hexanol FR sandal hexanol FR sandalwood fragrance FR sandalwood oil FL/FR sandalwood oil CO2 extract FL/FR sandalwood oil replacer FR sandalwood oil west australia FL/FR sandalwood oil west australia (santalum spicatum) FR santall FR santalum paniculatum wood oil FR siam wood oil FR vetiver oil bourbon FL/FR vetiver oil brazil FL/FR vetiver oil china FL/FR vetiver oil india FL/FR vetiverol FL/FR warburgia ugandensis wood oil FR (Z)- woody amylene FR For Flavor No flavor group found for these 1- acetyl cyclohexyl acetate FL allyl (E)-cinnamate FL/FR allyl cinnamate FL/FR balsam fir oleoresin FL/FR holy basil leaf oil FL/FR 1- benzoyl acetone FL/FR butyl angelate FL/FR butyl benzoate FL/FR (E)- cinnamyl butyrate FL/FR (E)- cinnamyl propionate FL/FR croton glabellus bark extract FL/FR dihydrocitronellyl acetate FL/FR ethyl ortho-anisate FL/FR fir needle oil canada FL/FR geranyl octanoate FL/FR geranyl valerate FL/FR alpha- guaiene FL/FR juniper absolute FL/FR linaloe wood oil mexico FL/FR linalool oxide acetates FL/FR marigold pot flower oil FL/FR 2- phenethyl valerate FL/FR white pine bark oil FL/FR pine needle absolute FL/FR prenyl benzoate FL/FR (E)- sabinene hydrate FL/FR sandalwood oil west australia FL/FR turpentine oil FL/FR anisic anisic para- anisyl phenyl acetate FL/FR balsamic siam benzoin resin FL/FR siam benzoin resinoid FL/FR laevo- bornyl acetate FL/FR iso butyl cinnamate FL/FR copaifera reticulata extract FL/FR ethyl cinnamate FL/FR fir needle oil terpeneless canada FL/FR juniper berry absolute FL/FR juniper berry oil CO2 extract FL/FR myrrh absolute FL/FR myrrh gum FL/FR myrrh resin FL/FR opoponax absolute (commiphora erythraea var. glabrescens engle) FL/FR peru balsam FL peru balsam absolute FL/FR iso propyl cinnamate FL/FR tolu balsam absolute FL/FR tolu balsam resin FL/FR tolu balsam resinoid FL/FR burnt ethyl 2-furoate FL camphoreous kaempferia galanga rhizome oil FL/FR rosemary oil tunisia FL/FR citrus petitgrain lemon oil FL/FR styralyl propionate FL/FR creamy 4- hydroxybenzaldehyde FL/FR earthy alpha- amyl cinnamyl acetate FL/FR floral cananga oil FL/FR cananga oil china FL/FR cinnamyl propionate FL/FR citronellyl acetate FL/FR citronellyl hexanoate FL/FR citronellyl propionate FL/FR cocoa pentenal FL/FR dimethyl benzyl carbinyl acetate FL/FR geraniol FL/FR geranyl isobutyrate FL/FR geranyl phenyl acetate FL/FR beta- ionol FL/FR alpha-iso methyl ionone (90% min.) FL/FR phenethyl propionate FL/FR rhodinyl butyrate FL/FR rose absolute (rosa centifolia) morocco FL/FR terpinyl butyrate FL/FR fruity iso amyl benzoate FL/FR benzyl acetone FL/FR benzyl alcohol FL/FR benzyl isobutyrate FL/FR boronia absolute FL/FR citronellyl anthranilate FL/FR dihydroactinidolide FL/FR (E)- ethyl tiglate FL/FR fusel oil FL/FR geranyl butyrate FL/FR hexyl phenyl acetate FL/FR phenethyl isovalerate FL/FR 3- phenyl propyl isobutyrate FL/FR (E)- propyl 2-furan acrylate FL/FR rose butanoate FL/FR valerian rhizome oil FL/FR valerian rhizome oil china FL/FR valerian rhizome oil CO2 extract china FL/FR greasy 10- undecen-1-yl acetate FL/FR green canarium luzonicum gum FL/FR (E)- citronellyl tiglate FL/FR elemi resinoid FL/FR galbanum absolute FL/FR galbanum oil FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR geranyl formate FL/FR octyl formate FL/FR herbal chamomile absolute FL/FR coriander oleoresin FL/FR lavender oil australia FL/FR linalyl formate FL/FR rosemary absolute FL/FR rosemary oil FL/FR rosemary oil africa FL/FR rosemary oil morocco FL/FR rosemary oil spain FL/FR honey honey absolute FL/FR phenethyl isobutyrate FL/FR nutty phytyl acetate FL/FR sesame absolute FL/FR sesame absolute CO2 extract FL/FR pine pine needle oil dwarf FL/FR sour 2- methyl-2-pentenoic acid FL/FR spicy siam benzoin absolute FL/FR benzyl cinnamate FL/FR cinnamyl formate FL/FR clove bud oil FL/FR clove leaf oil FL/FR elettaria cardamomum seed oil FL/FR elettaria cardamomum seed oil guatemala FL/FR galangal root oleoresin FL myristica fragrans fruit extract FL/FR myristica fragrans seed tincture FL/FR nutmeg absolute FL/FR spicy acetoacetate FL/FR tea green tea leaf absolute FL/FR waxy ethyl nonanoate FL/FR geranyl propionate FL/FR 4- phenyl-3-buten-2-ol FL/FR winey cinnamyl butyrate FL/FR woody amyris wood oil FL/FR copaiba balsam FL/FR beta- damascenone FL/FR delta- damascone FL/FR guaiacwood oil FL/FR beta- ionone FL/FR patchouli oil FL/FR sandalwood oil FL/FR sandalwood oil CO2 extract FL/FR vetiver oil bourbon FL/FR vetiver oil brazil FL/FR vetiver oil china FL/FR vetiver oil india FL/FR vetiverol FL/FR   Potential Uses: FR aldehydic FR amber FR balsam FR moss FR oriental FR rose FR woody   Occurrence (nature, food, other):note   not found in nature   Synonyms:   butanoic acid 5-(2,3-dimethyl tricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-2-pentenyl ester   butanoic acid, 5-(2,3-dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-2-pentenyl ester 5-(2,3- dimethyl tricyclo(2.2.1.0(2,6))hept-3-yl)-2-methyl-2-penten-1-yl butyrate 5-(2,3- dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methylpent-2-enyl butyrate   santalyl butyrate alpha- santalyl butyrate   Articles:   None found yet. 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